266983

Source:http://linkedlifedata.com/resource/chembl/compound/266983

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C18H32O3/c1-14(2)9-7-10-16(5)11-8-12-17(6)21-18(19)20-13-15(3)4/h9,11,15,17H,7-8,10,12-13H2,1-6H3/b16-11+
chemicalCompound:standardIn...	XOPJKGHDFAMGJE-LFIBNONCSA-N
chemicalCompound:canonicalS...	CC(C)COC(=O)OC(C)CC\C=C(/C)\CCC=C(C)C
chemicalCompound:molecularF...	C18 H32 O3
chemicalCompound:moleculeId	266983
chemicalCompound:mwFreebase	296.445
chemicalCompound:alogp	6.303
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	35.53
chemicalCompound:rtb	11
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	6.28
chemicalCompound:acdLogD	6.28
chemicalCompound:fullMwt	296.445
chemicalCompound:chemblId	CHEMBL161715
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:366983
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:1280941, activity:1280942, activity:1280943, activity:1280944